Compound Detail
CHEMBL3409837
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Basic Information
| ChEMBL ID | CHEMBL3409837 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OPIYSDPMUYQQAV-KADHNRKRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
279.3
MW (Da)
1.89
ALogP
4
HBA
1
HBD
54.9
PSA (Ų)
0.87
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mycobacterium marinum CHEMBL614987 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mycobacterium marinum | IC50 | = | 50000.0 | nM | 4.3 | Antituberculosis activity against Mycobacterium marinum assessed as growth inhib... | 25618016 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25618016 | 10.1016/j.ejmech.2015.01.020 | Mycobacterium marinum | 2 |
Data from ChEMBL 36 via Core Engine